CID 285609

3-(dimethylamino)-2,2-dimethylpropanoic acid hydrochloride

Structural Information

Molecular Formula
C7H15NO2
SMILES
CC(C)(CN(C)C)C(=O)O
InChI
InChI=1S/C7H15NO2/c1-7(2,6(9)10)5-8(3)4/h5H2,1-4H3,(H,9,10)
InChIKey
SWFRUSQUOVBPRQ-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-2,2-dimethylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

145.11028 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 131.9
[M+Na]+ 168.09950 138.2
[M-H]- 144.10300 132.5
[M+NH4]+ 163.14410 153.2
[M+K]+ 184.07344 139.3
[M+H-H2O]+ 128.10754 127.6
[M+HCOO]- 190.10848 153.6
[M+CH3COO]- 204.12413 180.0
[M+Na-2H]- 166.08495 136.9
[M]+ 145.10973 133.2
[M]- 145.11083 133.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe